PDB ligand accession: A1Y
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: LUTZBWBXBMVIOV-UHFFFAOYSA-N
SMILES: Cc1cc(nc(c1C#N)N2CCOCC2)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: 3-pyridinecarbonitriles
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5WBO | Download | Experimental | e5wboA1 e5wboB1 e5wboB1 | Rossmann-like Rossmann-like Rossmann-like | LigPlot |